SCHEMBL20831817

SCHEMBL20831817

CCc1ncccc1C(C)N1CCN(c2cnn(PI)c(=O)c2Cl)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TRPC5 Q9UL62 3/20 0.39
▸ MAPT P10636 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.35
▸ DCTPP1 Q9H773 3/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ CA12 O43570 2/20 0.34
▸ CA1 P00915 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ CA9 Q16790 2/20 0.34
▸ OGA O60502 1/20 0.34
▸ POLB P06746 1/20 0.33
▸ GAA P10253 1/20 0.32
▸ RAB9A P51151 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20818106 0.80 TRPC5 (0.62) TRPC5ALDH1A1POLB
SCHEMBL20818103 0.80 TRPC5 (0.62) TRPC5ALDH1A1POLB
SCHEMBL20818302 0.80 TRPC5 (0.62) TRPC5ALDH1A1POLB
SCHEMBL24433293 0.78 IDH1 (0.37) TRPC5MAPTALDH1A1DCTPP1RXFP1
SCHEMBL20818169 0.78 IDH1 (0.37) TRPC5MAPTALDH1A1DCTPP1RXFP1
SCHEMBL31574251 0.78 TRPC5 (0.37) TRPC5MAPTALDH1A1DCTPP1RXFP1
SCHEMBL20831709 0.77 GRM2 (0.35) —
SCHEMBL20818598 0.72 TRPC5 (0.60) TRPC5ALDH1A1POLB
SCHEMBL20818333 0.72 TRPC5 (0.60) TRPC5ALDH1A1POLB
SCHEMBL20818332 0.72 TRPC5 (0.60) TRPC5ALDH1A1POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230203028-A1 PYRIDAZINONES AND METHODS OF USE THEREOF GFB (ABC), LLC 2023-06-29 — — US disclosed
WO-2019055966-A2 PYRIDAZINONES AND METHODS OF USE THEREOF GOLDFINCH BIO, INC. (US) 2019-03-21 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230203028-A1 PYRIDAZINONES AND METHODS OF USE THEREOF PDXK, ATP6V1B1, REN TRPC5 1439/4885MAPT 26/4885ALDH1A1 649/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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